MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005187
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005187
RECORD_TITLE: BUTYL ACRYLATE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: BUTYL ACRYLATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H12O2
CH$EXACT_MASS: 128.08373
CH$SMILES: CCCCOC(=O)C=C
CH$IUPAC: InChI=1S/C7H12O2/c1-3-5-6-9-7(8)4-2/h4H,2-3,5-6H2,1H3
CH$LINK: COMPTOX
DTXSID6024676
CH$LINK: INCHIKEY
CQEYYJKEWSMYFG-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:8846
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE
PK$SPLASH: splash10-004i-0900000000-39834ba9d4eec38794e6
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
73 2.82 28
75 1.49 15
113 3.34 33
129 99.99 999
130 7.82 78
//
system version 2.2.8-SNAPSHOT